[5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]methyl methanesulfonate

Systemtic Name: [5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]methyl methanesulfonate Openeye Name: [5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)-3-pyrazolyl]methyl ester IUPAC Name: [5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]methyl ester Formula: C18H16Cl2N2O4S MolecularWeight: 427.30164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=CC(=N2)COS(=O)(=O)C)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=CC(=N2)COS(=O)(=O)C)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H16Cl2N2O4S/c1-25-15-6-4-14(5-7-15)22-18(12-3-8-16(19)17(20)9-12)10-13(21-22)11-26-27(2,23)24/h3-10H,11H2,1-2H3